Found 8 hits for monomerid = 50384789 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
DNA methyltransferase 1 (RFTS-lacking Dnmt1)
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | PDB
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| n/a | n/a | 650 | n/a | n/a | n/a | n/a | 7.5 | n/a |
University of Iowa
| Assay Description
Assays (0.1 ml) were conducted in 96-well black half-area plates in either a Wallac VICTOR2 or Biotek Synergy Neo plate reader at 37 °C in 10 mM Tri... |
J Biol Chem 288: 23858-67 (2013)
Article DOI: 10.1074/jbc.M113.480517
BindingDB Entry DOI: 10.7270/Q29885VG |
More data for this
Ligand-Target Pair | |
DNA methyltransferase 1 (RTFS-containing Dnmt1)
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | PDB
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| n/a | n/a | 1.91E+4 | n/a | n/a | n/a | n/a | 7.5 | n/a |
University of Iowa
| Assay Description
Assays (0.1 ml) were conducted in 96-well black half-area plates in either a Wallac VICTOR2 or Biotek Synergy Neo plate reader at 37 °C in 10 mM Tri... |
J Biol Chem 288: 23858-67 (2013)
Article DOI: 10.1074/jbc.M113.480517
BindingDB Entry DOI: 10.7270/Q29885VG |
More data for this
Ligand-Target Pair | |
DNA methyltransferase 1 (RFTS-lacking Dnmt1)
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | PDB
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| n/a | n/a | 2.78E+4 | n/a | n/a | n/a | n/a | 7.5 | n/a |
University of Iowa
| Assay Description
Assays (0.1 ml) were conducted in 96-well black half-area plates in either a Wallac VICTOR2 or Biotek Synergy Neo plate reader at 37 °C in 10 mM Tri... |
J Biol Chem 288: 23858-67 (2013)
Article DOI: 10.1074/jbc.M113.480517
BindingDB Entry DOI: 10.7270/Q29885VG |
More data for this
Ligand-Target Pair | |
G-protein coupled receptor 35
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Desensitization of GPR35 receptor in human HT-29 cells assessed as inhibition of zaprinast-induced dynamic mass redistribution after 10 mins |
ACS Med Chem Lett 3: 165-169 (2012)
Article DOI: 10.1021/ml2003058
BindingDB Entry DOI: 10.7270/Q2DB82W9 |
More data for this
Ligand-Target Pair | |
M.SssI methyltransferase
(Spiroplasma monobiae strain MQ-1) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | UniProtKB/SwissProt
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| n/a | n/a | 5.36E+4 | n/a | n/a | n/a | n/a | 7.5 | n/a |
University of Iowa
| Assay Description
Assays (0.1 ml) were conducted in 96-well black half-area plates in either a Wallac VICTOR2 or Biotek Synergy Neo plate reader at 37 °C in 10 mM Tri... |
J Biol Chem 288: 23858-67 (2013)
Article DOI: 10.1074/jbc.M113.480517
BindingDB Entry DOI: 10.7270/Q29885VG |
More data for this
Ligand-Target Pair | |
G-protein coupled receptor 35
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Agonist activity at GPR35 receptor in human HT-29 cells after 10 mins by dynamic mass redistribution assay |
ACS Med Chem Lett 3: 165-169 (2012)
Article DOI: 10.1021/ml2003058
BindingDB Entry DOI: 10.7270/Q2DB82W9 |
More data for this
Ligand-Target Pair | |
G-protein coupled receptor 35
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | KEGG
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TBA
Curated by ChEMBL
| Assay Description
Agonist activity at GPR35 receptor in human U2OS cells coexpressing Gal4-VP16-TEV assessed as beta arrestin translocation after 5 hrs by beta lactmas... |
ACS Med Chem Lett 3: 165-169 (2012)
Article DOI: 10.1021/ml2003058
BindingDB Entry DOI: 10.7270/Q2DB82W9 |
More data for this
Ligand-Target Pair | |
DNA methyltransferase 3a (Dnmt3a)
(Homo sapiens (Human)) | BDBM50384789
(CHEMBL2037378 | Laccaic acid A (LCA))Show SMILES CC(=O)NCCc1ccc(O)c(c1)-c1c(O)c(O)c2C(=O)c3cc(O)c(C(O)=O)c(C(O)=O)c3C(=O)c2c1O |(18.51,2.43,;18.52,.89,;19.87,.13,;17.2,.1,;17.22,-1.44,;15.9,-2.22,;15.92,-3.76,;17.26,-4.52,;17.28,-6.06,;15.95,-6.84,;15.96,-8.38,;14.61,-6.08,;14.6,-4.54,;13.29,-6.86,;13.31,-8.42,;14.64,-9.18,;11.96,-9.2,;11.97,-10.74,;10.62,-8.43,;9.28,-9.21,;9.28,-10.75,;7.94,-8.44,;6.6,-9.21,;5.27,-8.44,;3.93,-9.21,;5.27,-6.89,;3.93,-6.12,;2.6,-6.89,;3.93,-4.59,;6.59,-6.12,;6.59,-4.59,;5.26,-3.82,;7.92,-3.81,;7.93,-6.89,;9.26,-6.1,;9.26,-4.56,;10.61,-6.88,;11.95,-6.09,;11.93,-4.56,)| Show InChI InChI=1S/C26H19NO12/c1-8(28)27-5-4-9-2-3-12(29)10(6-9)15-22(33)19-18(24(35)23(15)34)20(31)11-7-13(30)16(25(36)37)17(26(38)39)14(11)21(19)32/h2-3,6-7,29-30,33-35H,4-5H2,1H3,(H,27,28)(H,36,37)(H,38,39) | PDB
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| n/a | n/a | 5.05E+4 | n/a | n/a | n/a | n/a | 7.5 | n/a |
University of Iowa
| Assay Description
Assays (0.1 ml) were conducted in 96-well black half-area plates in either a Wallac VICTOR2 or Biotek Synergy Neo plate reader at 37 °C in 10 mM Tri... |
J Biol Chem 288: 23858-67 (2013)
Article DOI: 10.1074/jbc.M113.480517
BindingDB Entry DOI: 10.7270/Q29885VG |
More data for this
Ligand-Target Pair | |
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